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3-(4-fluoro-phenyl)-1-hexyl-2-methyl-1H-indole-5-ol

HCID 20529072
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Basic information

Standard SMILES
CCCCCCn1c(C)c(-c2ccc(F)cc2)c2cc(O)ccc21
InChIKey
POKOTYLPIYTRNX-UHFFFAOYSA-N
Molecular formula
C21H24FNO
Average molar mass
325.4 g/mol

Names & identifiers

Preferred name
3-(4-fluoro-phenyl)-1-hexyl-2-methyl-1H-indole-5-ol
IUPAC
3-(4-fluorophenyl)-1-hexyl-2-methylindol-5-ol

Names & synonyms

SCHEMBL11262223POKOTYLPIYTRNX-UHFFFAOYSA-N3-(4-fluoro-phenyl)-1-hexyl-2-methyl-1H-indole-5-ol

Database identifiers

PubChem CID
20529072

Properties

Computed structural properties

XLogP
6
Topological polar surface area
25.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
24
Formal charge
0
Complexity
382

Related reactions

2 records
New reaction record
HRID 66842 reaction equation
HRID 66842As reactantuspto-grants-1982_08
HRID 2158861 reaction equation
HRID 2158861As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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